1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one

C19H20N2O — CID 166350533

IUPAC1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one
SMILESCn1c(=O)n(CCC2CCc3ccccc32)c2ccccc21
InChIInChI=1S/C19H20N2O/c1-20-17-8-4-5-9-18(17)21(19(20)22)13-12-15-11-10-14-6-2-3-7-16(14)15/h2-9,15H,10-13H2,1H3
InChIKeyBTPDUYUHYBYIIZ-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.46
Rot. Bonds3

About 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one

1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one (PubChem CID 166350533) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one.

Molecular Properties

Compound Name1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one
PubChem CID166350533
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one
SMILESCn1c(=O)n(CCC2CCc3ccccc32)c2ccccc21
InChIInChI=1S/C19H20N2O/c1-20-17-8-4-5-9-18(17)21(19(20)22)13-12-15-11-10-14-6-2-3-7-16(14)15/h2-9,15H,10-13H2,1H3
InChIKeyBTPDUYUHYBYIIZ-UHFFFAOYSA-N
XLogP3.46
TPSA26.93 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(1,3-dioxan-2-yl)ethyl]-3-methylbenzimidazol-2-one
CID 66474341
1-[2-(2-oxocyclopentyl)ethyl]-3-propylbenzimidazol-2-one
CID 79577144
1-ethyl-2,3-dihydro-1H-indene
CID 20971
N-cyclopropyl-2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 55592024
(1R)-1-hexadecyl-2,3-dihydro-1H-indene
CID 98094176
1-(cyclobutylmethyl)-3-methylbenzimidazol-2-one
CID 115761324
2-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-ethylethanamine
CID 124705366
1-methyl-3-(2-methylsulfonylethyl)benzimidazol-2-one
CID 115591774
1-[(4-aminocyclohexyl)methyl]-3-methylbenzimidazol-2-one
CID 67339990
1-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-3-ethylbenzimidazol-2-one
CID 116621220
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
1-[2-(methylamino)ethyl]-3-[1-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidin-4-yl]benzimidazol-2-one
CID 59322987

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one?
The IUPAC name of 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one (CID 166350533) is 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one.
What is the SMILES notation for 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one?
The canonical SMILES for 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one is Cn1c(=O)n(CCC2CCc3ccccc32)c2ccccc21.
What is the InChIKey of 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one?
The InChIKey is BTPDUYUHYBYIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-20-17-8-4-5-9-18(17)21(19(20)22)13-12-15-11-10-14-6-2-3-7-16(14)15/h2-9,15H,10-13H2,1H3.
What are the key properties of 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one?
1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one has a molecular weight of 292.38 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,3-dihydro-1H-inden-1-yl)ethyl]-3-methylbenzimidazol-2-one is sourced from PubChem (CID 166350533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).